2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide

C9H15N3O2 — CID 42656286

IUPAC2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide
SMILESCCC(C)NCC(=O)Nc1ccon1
InChIInChI=1S/C9H15N3O2/c1-3-7(2)10-6-9(13)11-8-4-5-14-12-8/h4-5,7,10H,3,6H2,1-2H3,(H,11,12,13)
InChIKeyCSQAXYYSQUVCGE-UHFFFAOYSA-N
MW197.24 g/mol
LogP1.00
Rot. Bonds5

About 2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide

2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide (PubChem CID 42656286) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide
PubChem CID42656286
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide
SMILESCCC(C)NCC(=O)Nc1ccon1
InChIInChI=1S/C9H15N3O2/c1-3-7(2)10-6-9(13)11-8-4-5-14-12-8/h4-5,7,10H,3,6H2,1-2H3,(H,11,12,13)
InChIKeyCSQAXYYSQUVCGE-UHFFFAOYSA-N
XLogP1.00
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,2-oxazol-3-yl)-3-oxobutanamide
CID 62902230
4-methyl-N-(1,2-oxazol-3-yl)pentanamide
CID 130694533
2-(butan-2-ylamino)-N-pyridin-2-ylacetamide
CID 60852283
2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide
CID 21430532
2-[[(2S)-butan-2-yl]amino]-N-(3-methylphenyl)acetamide
CID 2386923
2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide
CID 114932408
2-(butan-2-ylamino)-N-(4-chlorophenyl)acetamide
CID 43179385
2-[[(2S)-butan-2-yl]amino]-N-(4-fluorophenyl)acetamide
CID 28565900
N-(4-bromophenyl)-2-(butan-2-ylamino)acetamide
CID 43179384
2-(butan-2-ylamino)-N-[4-(carbamoylamino)phenyl]acetamide
CID 60852680
2-(butan-2-ylamino)-N-(3-hydroxyphenyl)acetamide
CID 61166125
N-(1,3-benzothiazol-6-yl)-2-(butan-2-ylamino)acetamide
CID 114003189

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide (CID 42656286) is 2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide is CCC(C)NCC(=O)Nc1ccon1.
What is the InChIKey of 2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide?
The InChIKey is CSQAXYYSQUVCGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-3-7(2)10-6-9(13)11-8-4-5-14-12-8/h4-5,7,10H,3,6H2,1-2H3,(H,11,12,13).
What are the key properties of 2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide?
2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide has a molecular weight of 197.24 g/mol, XLogP of 1.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 42656286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).